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EVODEX.1-P131

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[O:11]=[O:12].[H][C:7]([C:6]1:[C:5]([H:14]):[C:4]([H:13]):[C:3]([C:2](=[O:1])[H:18]):[O:10]:1)([O:8][H])[O:9][H:16]>>[O:1]=[C:2]([C:3]1:[C:4]([H:13]):[C:5]([H:14]):[C:6]([C:7](=[O:8])[O:9][H:16]):[O:10]:1)[H:18].[H][O:11][O:12][H]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E196 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:1]=[#8:2].[#8:10]-[#6:11](-[#8:12]-[H])(-[H])-[#6@@:13]>>[#8:10]-[#6:11](=[#8:12])-[#6@@:13].[#8:1](-[#8:2]-[H])-[H]

EVODEX.1-C40 - Reaction Operator C

Reaction Operator C SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4]-[H]>>[#8:3]=[#6:4].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-N1191 - Reaction Operator N

Reaction Operator N SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6@:11]>>[#8:3]=[#6:4](-[#8:5])-[#6@:11].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Em183 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6:11]>>[#8:3]=[#6:4](-[#8:5])-[#6:11].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Cm63 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4]-[H]>>[#8:3]=[#6:4].[H]-[#8:1]-[#8:2]-[H]

EVODEX.1-Nm190 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#8:1]=[#8:2].[H]-[#8:3]-[#6:4](-[H])(-[#8:5])-[#6:11]>>[#8:3]=[#6:4](-[#8:5])-[#6:11].[H]-[#8:1]-[#8:2]-[H]

Source Full Reactions

EVODEX.1-R172

Full Reaction Rendering

[O:11]=[O:12].[H][C:7]([C:6]1:[C:5]([H:14]):[C:4]([H:13]):[C:3]([C:2](=[O:1])[H:18]):[O:10]:1)([O:8][H])[O:9][H:16]>>[O:1]=[C:2]([C:3]1:[C:4]([H:13]):[C:5]([H:14]):[C:6]([C:7](=[O:8])[O:9][H:16]):[O:10]:1)[H:18].[H][O:11][O:12][H]